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2,3-dihydronaphtho[1,8-bc][1,5]thiazocin-4(5H)-one
TL;DR: 2,3-dihydronaphtho[1,8-bc][1,5]thiazocin-4(5H)-one (CAS 433240-84-7) is a chemical compound with molecular formula C13H11NOS and molecular weight 229.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-thia-14-azatricyclo[7.5.1.05,15]pentadeca-1,3,5(15),6,8-pentaen-13-one
Also Known As: 2,3-dihydronaphtho[1,8-bc][1,5]thiazocin-4(5H)-one, BAS 05210321, AB00122143-01, 10-thia-14-azatricyclo[7.5.1.05,15]pentadeca-1,3,5(15),6,8-pentaen-13-one, 8,9-Dihydro-11H-7-thia-11-aza-cycloocta[de]naphthalen-10-one
| Molecular Formula | C13H11NOS |
|---|---|
| Molecular Weight | 229.06 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 229.05614 |
| Heavy Atoms | 16 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 433240-84-7 |
|---|---|
| SMILES | C1CSC2=CC=CC3=C2C(=CC=C3)NC1=O |
| InChIKey | DPKIUHXJZFUQLC-UHFFFAOYSA-N |
Product Overview
2,3-dihydronaphtho[1,8-bc][1,5]thiazocin-4(5H)-one (CAS 433240-84-7), with molecular formula C13H11NOS and molecular weight 229.06 g/mol. IUPAC: 10-thia-14-azatricyclo[7.5.1.05,15]pentadeca-1,3,5(15),6,8-pentaen-13-one.
Chemical Property Profile of 2,3-dihydronaphtho[1,8-bc][1,5]thiazocin-4(5H)-one
Property Insights of 2,3-dihydronaphtho[1,8-bc][1,5]thiazocin-4(5H)-one
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-dihydronaphtho[1,8-bc][1,5]thiazocin-4(5H)-one. With a topological polar surface area (TPSA) of 54.4 Ų, 2,3-dihydronaphtho[1,8-bc][1,5]thiazocin-4(5H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-dihydronaphtho[1,8-bc][1,5]thiazocin-4(5H)-one has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,3-dihydronaphtho[1,8-bc][1,5]thiazocin-4(5H)-one?
The CAS number of 2,3-dihydronaphtho[1,8-bc][1,5]thiazocin-4(5H)-one is 433240-84-7.
What is the molecular formula of 2,3-dihydronaphtho[1,8-bc][1,5]thiazocin-4(5H)-one?
The molecular formula of 2,3-dihydronaphtho[1,8-bc][1,5]thiazocin-4(5H)-one is C13H11NOS.
What is the molecular weight of 2,3-dihydronaphtho[1,8-bc][1,5]thiazocin-4(5H)-one?
The molecular weight of 2,3-dihydronaphtho[1,8-bc][1,5]thiazocin-4(5H)-one is 229.06 g/mol.
Where can I buy 2,3-dihydronaphtho[1,8-bc][1,5]thiazocin-4(5H)-one?
You can request a quote for 2,3-dihydronaphtho[1,8-bc][1,5]thiazocin-4(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-dihydronaphtho[1,8-bc][1,5]thiazocin-4(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2,3-dihydronaphtho[1,8-bc][1,5]thiazocin-4(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.